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Home > Other Heterocycles > 827599-22-4
827599-22-4 | endo-3-Azabicyclo[3.1.0]hexane-6-methanol
CAS No: 827599-22-4 Catalog No: AG00IKV8 MDL No:
Product Description
Catalog Number:
AG00IKV8
Chemical Name:
endo-3-Azabicyclo[3.1.0]hexane-6-methanol
CAS Number:
827599-22-4
Molecular Formula:
C6H11NO
Molecular Weight:
113.1576
IUPAC Name:
[(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]methanol
InChI:
InChI=1S/C6H11NO/c8-3-6-4-1-7-2-5(4)6/h4-8H,1-3H2/t4-,5+,6?
InChI Key:
YGYOQZPGFXHQMW-XEAPYIEGSA-N
SMILES:
OC[C@@H]1[C@H]2[C@@H]1CNC2
Properties
Complexity:
94.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
113.084g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
113.16g/mol
Monoisotopic Mass:
113.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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